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06/14/2023
GHP-MOFassemble: Diffusion modeling, high throughput screening, and molecular dynamics for rational discovery of novel metal-organic frameworks for carbon capture at scale
We introduce GHP-MOFassemble, a Generative artificial intelligence (AI),...
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04/15/2023
A framework for fully autonomous design of materials via multiobjective optimization and active learning: challenges and next steps
In order to deploy machine learning in a real-world self-driving laborat...
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12/21/2022
End-to-end AI Framework for Hyperparameter Optimization, Model Training, and Interpretable Inference for Molecules and Crystals
We introduce an end-to-end computational framework that enables hyperpar...
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05/03/2022
Real-Time Streaming and Event-driven Control of Scientific Experiments
Advancements in scientific instrument sensors and connected devices prov...
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04/16/2022
Physics-Informed Bayesian Learning of Electrohydrodynamic Polymer Jet Printing Dynamics
Calibration of highly dynamic multi-physics manufacturing processes such...
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10/16/2020
Towards Online Steering of Flame Spray Pyrolysis Nanoparticle Synthesis
Flame Spray Pyrolysis (FSP) is a manufacturing technique to mass produce...
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05/27/2020